2-nitro-N-(2-pyridin-2-ylethylcarbamoyl)benzeneamine oxide

Systemtic Name: 2-nitro-N-(2-pyridin-2-ylethylcarbamoyl)benzeneamine oxide Openeye Name: 2-nitro-N-[2-(2-pyridyl)ethylcarbamoyl]benzeneamine oxide CAS Name: 2-nitro-N-[oxo-[2-(2-pyridinyl)ethylamino]methyl]benzeneamine oxide IUPAC Name: 2-nitro-N-(2-pyridin-2-ylethylcarbamoyl)benzeneamine oxide Traditional Name: 2-nitro-N-[2-(2-pyridyl)ethylcarbamoyl]benzeneamine oxide Formula: C14H14N4O4 MolecularWeight: 302.28536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[NH+](C(=O)NCCC2=CC=CC=N2)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)[NH+](C(=O)NCCC2=CC=CC=N2)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H14N4O4/c19-14(16-10-8-11-5-3-4-9-15-11)17(20)12-6-1-2-7-13(12)18(21)22/h1-7,9,17H,8,10H2,(H,16,19)